V031-0273 Screening compound: 8-[(4-{3-methyl-6-[(4-methylphenyl)methyl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}-1,4-diazepan-1-yl)sulfonyl]quinoline

V031-0273 Screening compound: 8-[(4-{3-methyl-6-[(4-methylphenyl)methyl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}-1,4-diazepan-1-yl)sulfonyl]quinoline
V031-0273 Screening compound: 8-[(4-{3-methyl-6-[(4-methylphenyl)methyl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}-1,4-diazepan-1-yl)sulfonyl]quinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound V031-0273
8-[(4-{3-methyl-6-[(4-methylphenyl)methyl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}-1,4-diazepan-1-yl)sulfonyl]quinoline

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

V031-0273

Molecular Formula

C34H33N7O2S (C34 H33 N7 O2 S)

Compound Name

8-[(4-{3-methyl-6-[(4-methylphenyl)methyl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}-1,4-diazepan-1-yl)sulfonyl]quinoline

IUPAC name

8-[(4-{3-methyl-6-[(4-methylphenyl)methyl]-1-phenyl-1H-pyrazolo[34-d]pyrimidin-4-yl}-14-diazepan-1-yl)sulfonyl]quinoline

SMILES

Cc(c1c2nc(Cc3ccc(C)cc3)nc1N(CCC1)CCN1S(c1cccc3cccnc13)(=O)=O)nn2-c1ccccc1

InChI

InChI=1S/C34H33N7O2S/c1-24-14-16-26(17-15-24)23-30-36-33(31-25(2)38-41(34(31)37-30)28-11-4-3-5-12-28)39-19-8-20-40(22-21-39)44(42,43)29-13-6-9-27-10-7-18-35-32(27)29/h3-7,9-18H,8,19-23H2,1-2H3

InChI Key

ZBJSWNXZLNSYJZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19856960

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

603.75

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

5.681

Distribution Coefficient, logD

5.579

Water Solubility, LogSw

-6.13

Polar Surface Area

79.077

Acid Dissociation Constant (pKa)

21.44

Base Dissociation Constant (pKb)

6.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

References: we are preparing a list of scientific research reports with V031-0273 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V031-0273?
Check Price and Availability of V031-0273, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V031-0273 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V031-0273
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V031-0273
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of V031-0273 available by request